SCHEMBL9469697

SCHEMBL9469697

CC(C)(C)[Si](C)(C)OCCSC1C(=O)N(c2ccccc2)c2ncccc21

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
DUT P33316 2/20 0.31
POLB P06746 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9470320 0.82 SLC18A3 (0.34) ALDH1A1LMNAPOLB
SCHEMBL9469702 0.80 POLB (0.48) ALDH1A1LMNAPOLB
SCHEMBL9470368 0.72 ALDH1A1 (0.43) ALDH1A1LMNAPOLB
SCHEMBL9469636 0.70 ALDH1A1 (0.39) ALDH1A1LMNA
SCHEMBL9470596 0.70 TP53 (0.40) ALDH1A1LMNA
SCHEMBL9470115 0.70 ALDH1A1 (0.45) ALDH1A1
SCHEMBL9470178 0.69 MAOA (0.41) ALDH1A1LMNAPOLB
SCHEMBL9470503 0.68 ALDH1A1 (0.40) ALDH1A1LMNAPOLB
SCHEMBL9470196 0.68 ALDH1A1 (0.39) ALDH1A1LMNA
SCHEMBL20067119 0.67 PSEN1 (0.39) DUT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5182289-A Pyrrolo 2,3-b!Pyridin-2-one Derivatives SCHERING CORPORATION (US) 1993-01-26 US disclosed
EP-0419561-A1 HETEROBICYCLIC COMPOUNDS HAVING ANTIINFLAMMATORY ACTIVITY SCHERING CORPORATION (US) 1991-04-03 EP disclosed
WO-1989012637-A1 HETEROBICYCLIC COMPOUNDS HAVING ANTIINFLAMMATORY ACTIVITY SCHERING CORPORATION (US) 1989-12-28 WO disclosed